SCHEMBL3978880

SCHEMBL3978880

COC(=O)Cn1cncc1C(C)(C)O[SiH2]C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.36
CYP11B2 P19099 6/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
QPCT Q16769 1/20 0.32
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3275833 0.74 CYP11B1 (0.43) CYP11B1CYP11B2SMN1; SMN2QPCT
SCHEMBL480924 0.71 SYK (0.33) SMN1; SMN2ALDH1A1
SCHEMBL28652330 0.69 KMT2A (0.38) SMN1; SMN2KMT2AGAA
SCHEMBL25311885 0.68 CYP11B1 (0.48) CYP11B1CYP11B2SMN1; SMN2KMT2AALDH1A1
SCHEMBL4489945 0.68 CYP11B1 (0.48) CYP11B1CYP11B2SMN1; SMN2KMT2AALDH1A1
SCHEMBL3978013 0.67 CYP11B1 (0.41) CYP11B1CYP11B2SMN1; SMN2KMT2AALDH1A1
SCHEMBL28645660 0.67 SMN1; SMN2 (0.34) SMN1; SMN2GAA
SCHEMBL3978876 0.66 CYP11B1 (0.41) CYP11B1CYP11B2SMN1; SMN2KMT2AALDH1A1
SCHEMBL3978875 0.65 CYP11B1 (0.38) CYP11B1CYP11B2SMN1; SMN2KMT2AALDH1A1
SCHEMBL20518661 0.65 PTGS2 (0.41) ALDH1A1GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264420-A1 ORGANIC COMPOUNDS KSANDER GARY MICHAEL 2009-10-22 US disclosed
EP-2057163-A1 FUSED IMIDAZOLE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY ALDOSTERONE SYNTHASE AND/OR 11-BETA-HYDROXYLASE AND/OR AROMATASE Novartis AG (CH) 2009-05-13 EP disclosed
WO-2008027284-A1 FUSED IMIDAZOLE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY ALDOSTERONE SYNTHASE AND/OR 11-BETA-HYDROXYLASE AND/OR AROMATASE NOVARTIS AG (CH) 2008-03-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090264420-A1 ORGANIC COMPOUNDS CYP17A1, CYP11B1, CYP46A1 CYP11B1 2/4885CYP11B2 11/4885SMN1; SMN2 4550/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.